pentan-3-yl octanoate

Systemtic Name: pentan-3-yl octanoate Openeye Name: 1-ethylpropyl octanoate CAS Name: octanoic acid pentan-3-yl ester IUPAC Name: pentan-3-yl octanoate Traditional Name: caprylic acid 1-ethylpropyl ester Formula: C13H26O2 MolecularWeight: 214.34434

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)OC(CC)CC

Isomeric SMILES

CCCCCCCC(=O)OC(CC)CC

InChI

InChI=1S/C13H26O2/c1-4-7-8-9-10-11-13(14)15-12(5-2)6-3/h12H,4-11H2,1-3H3